# data_comp_list loop_ _chem_comp.id _chem_comp.three_letter_code _chem_comp.name _chem_comp.group _chem_comp.number_atoms_all _chem_comp.number_atoms_nh _chem_comp.desc_level CSD CSD '3-SULFINOALANINE ' non-polymer 16 9 M # data_comp_CSD # loop_ _chem_comp_atom.comp_id _chem_comp_atom.atom_id _chem_comp_atom.type_symbol _chem_comp_atom.type_energy _chem_comp_atom.partial_charge CSD N N . 0.000 CSD CA C . 0.000 CSD CB C . 0.000 CSD SG S . 0.000 CSD C C . 0.000 CSD O O . 0.000 CSD OXT O . 0.000 CSD OD1 O . 0.000 CSD OD2 O . 0.000 CSD HN1 H . 0.000 CSD HN2 H . 0.000 CSD HA H . 0.000 CSD HB1 H . 0.000 CSD HB2 H . 0.000 CSD HD2 H . 0.000 CSD HXT H . 0.000 loop_ _chem_comp_bond.comp_id _chem_comp_bond.atom_id_1 _chem_comp_bond.atom_id_2 _chem_comp_bond.type CSD N CA single CSD N HN1 single CSD N HN2 single CSD CA CB single CSD CA C single CSD CA HA single CSD CB SG single CSD CB HB1 single CSD CB HB2 single CSD SG OD1 double CSD SG OD2 single CSD C O double CSD C OXT single CSD OXT HXT single CSD OD2 HD2 single